#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zdx s GLN 26 N 0.00 0.16 0.00 1.61 -0.44 -1.26 -3.40 119.66 116.33 1zdx s GLN 26 Ca 0.00 0.39 0.00 0.00 -2.50 0.00 0.00 55.36 53.25 1zdx s GLN 26 Cb 0.00 -0.79 0.00 0.00 -1.64 0.00 0.00 33.01 30.58 1zdx s GLN 26 CO 0.00 -0.52 0.77 -0.85 0.50 0.00 0.00 175.29 175.19 1zdx n GLU 27 N 5.33 0.00 -3.28 1.67 0.28 -0.37 -4.98 120.64 119.29 1zdx n GLU 27 Ca -0.05 -0.54 -0.03 0.00 -0.16 0.00 0.00 57.16 56.38 1zdx n GLU 27 Cb 0.50 -0.27 -0.05 0.00 1.43 0.00 0.00 31.44 33.05 1zdx n GLU 27 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1zdx s LEU 28 N 0.00 -0.99 0.53 -1.84 2.96 -1.04 -5.02 118.68 113.28 1zdx s LEU 28 Ca 0.00 0.59 -0.18 0.00 -0.22 0.00 0.00 54.13 54.33 1zdx s LEU 28 Cb 0.00 1.64 -0.07 0.00 0.50 0.00 0.00 46.19 48.26 1zdx s LEU 28 CO 0.00 -0.28 1.02 -2.16 -1.32 0.00 0.00 176.35 173.61 1zdx s PRO 29 N 2.70 3.71 0.92 0.98 0.04 -1.26 -4.51 135.00 137.58 1zdx s PRO 29 Ca 0.15 1.16 -0.12 0.00 0.04 0.00 0.00 61.00 62.23 1zdx s PRO 29 Cb -0.15 -2.09 0.14 0.00 0.04 0.00 0.00 34.50 32.44 1zdx s PRO 29 CO -0.18 -0.48 1.09 -1.25 0.04 0.00 0.00 177.00 176.22 1zdx s PRO 30 N -3.79 1.03 0.00 0.56 0.04 -1.26 -5.00 135.00 126.58 1zdx s PRO 30 Ca 0.63 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.45 1zdx s PRO 30 Cb -0.13 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1zdx s PRO 30 CO 0.29 -2.39 0.00 0.41 0.04 0.00 0.00 177.00 175.35 1zdx n GLY 31 N -1.03 -0.59 2.84 0.56 0.00 -1.26 -5.07 105.19 100.63 1zdx n GLY 31 Ca 0.07 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.35 1zdx n GLY 31 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1zdx s THR 32 N -4.00 0.02 -0.08 2.61 -1.32 -1.26 -2.49 115.64 109.12 1zdx s THR 32 Ca 0.00 0.06 0.02 0.00 -1.21 0.00 0.00 61.69 60.56 1zdx s THR 32 Cb 0.00 -0.07 0.01 0.00 -1.51 0.00 0.00 72.50 70.93 1zdx s THR 32 CO 0.00 0.05 -0.15 -0.72 -2.21 0.00 0.00 174.62 171.58 1zdx s TYR 33 N 0.40 1.82 -0.28 9.09 -0.85 -0.91 -4.88 117.35 121.74 1zdx s TYR 33 Ca -0.03 -0.74 -0.29 0.00 -0.52 0.00 0.00 57.07 55.48 1zdx s TYR 33 Cb -0.05 -1.30 -0.01 0.00 0.38 0.00 0.00 41.96 40.98 1zdx s TYR 33 CO -0.01 -0.36 1.48 0.50 -1.52 0.00 0.00 175.55 175.64 1zdx s ARG 34 N 0.69 3.79 0.18 -3.49 3.00 -1.26 -0.49 118.95 121.38 1zdx s ARG 34 Ca -0.13 1.40 -0.14 0.00 -1.00 0.00 0.00 55.73 55.86 1zdx s ARG 34 Cb -0.16 -3.98 0.01 0.00 0.00 0.00 0.00 34.95 30.82 1zdx s ARG 34 CO 0.03 -1.29 0.43 0.14 0.00 0.00 0.00 175.30 174.61 1zdx s VAL 35 N 4.98 0.04 -0.23 7.11 -7.23 -0.49 -4.80 120.40 119.79 1zdx s VAL 35 Ca 0.65 -1.05 -0.13 0.00 -1.81 0.00 0.00 61.98 59.64 1zdx s VAL 35 Cb -0.20 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 1zdx s VAL 35 CO 0.27 -0.19 0.27 -1.81 -0.31 0.00 0.00 175.10 173.33 1zdx s ASP 36 N -2.92 6.24 -0.91 4.85 -0.00 -0.16 -1.98 116.67 121.79 1zdx s ASP 36 Ca 0.13 0.26 -0.25 0.00 -0.00 0.00 0.00 52.55 52.69 1zdx s ASP 36 Cb 0.01 -2.16 0.04 0.00 -0.00 0.00 0.00 42.92 40.81 1zdx s ASP 36 CO -0.01 -0.02 1.41 -0.63 -0.00 0.00 0.00 175.17 175.92 1zdx s ILE 37 N 1.29 3.82 -0.86 0.77 1.09 0.58 -0.34 121.20 127.55 1zdx s ILE 37 Ca 0.12 -0.30 -0.16 0.00 -1.10 0.00 0.00 60.65 59.21 1zdx s ILE 37 Cb -0.14 -4.96 0.18 0.00 -1.06 0.00 0.00 42.46 36.48 1zdx s ILE 37 CO 0.07 -1.87 0.90 -0.31 -0.10 0.00 0.00 174.94 173.63 1zdx s TYR 38 N 5.46 3.51 -0.17 3.97 2.02 -0.48 -0.37 117.35 131.29 1zdx s TYR 38 Ca 0.43 -1.75 -0.25 0.00 -0.37 0.00 0.00 57.07 55.13 1zdx s TYR 38 Cb -0.03 -4.00 -0.02 0.00 -0.40 0.00 0.00 41.96 37.51 1zdx s TYR 38 CO 0.00 -1.18 0.81 -1.17 -1.57 0.00 0.00 175.55 172.43 1zdx s LEU 39 N 1.16 4.17 -1.66 -1.29 2.96 -1.25 -1.76 118.68 121.01 1zdx s LEU 39 Ca 0.23 1.13 -0.12 0.00 -0.22 0.00 0.00 54.13 55.15 1zdx s LEU 39 Cb -0.08 -3.19 0.11 0.00 0.50 0.00 0.00 46.19 43.53 1zdx s LEU 39 CO -0.09 -0.38 0.48 0.59 -1.32 0.00 0.00 176.35 175.63 1zdx n ASN 40 N 5.21 -1.36 -3.30 3.68 3.02 -0.12 -1.20 115.26 121.20 1zdx n ASN 40 Ca 0.04 -1.13 -0.16 0.00 -0.03 0.00 0.00 54.58 53.29 1zdx n ASN 40 Cb 0.49 -2.24 0.07 0.00 -0.61 0.00 0.00 39.78 37.49 1zdx n ASN 40 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1zdx n ASN 41 N -2.72 -5.77 0.00 6.41 3.02 -1.26 -4.98 115.26 109.96 1zdx n ASN 41 Ca -0.08 -0.71 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 1zdx n ASN 41 Cb 0.57 -5.12 0.00 0.00 -0.61 0.00 0.00 39.78 34.62 1zdx n ASN 41 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zdx n GLY 42 N -1.24 0.87 2.36 7.41 0.00 -0.34 -5.15 105.19 109.10 1zdx n GLY 42 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 1zdx n GLY 42 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1zdx n TYR 43 N 0.00 -3.47 -0.01 1.61 9.36 -1.26 -4.88 117.16 118.51 1zdx n TYR 43 Ca 0.00 2.06 0.01 0.00 3.32 0.00 0.00 57.90 63.29 1zdx n TYR 43 Cb 0.00 -3.08 -0.04 0.00 -0.63 0.00 0.00 39.34 35.60 1zdx n TYR 43 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1zdx n MET 44 N 1.91 1.16 -3.60 2.98 2.81 0.50 -4.91 117.12 117.97 1zdx n MET 44 Ca -0.06 -0.03 -0.03 0.00 -1.81 0.00 0.00 57.70 55.76 1zdx n MET 44 Cb 0.10 -1.12 -0.02 0.00 -0.71 0.00 0.00 33.22 31.46 1zdx n MET 44 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1zdx s ALA 45 N -2.28 -2.10 -0.23 3.04 0.00 -1.25 -4.83 121.76 114.11 1zdx s ALA 45 Ca -0.02 1.42 -0.03 0.00 0.00 0.00 0.00 51.96 53.33 1zdx s ALA 45 Cb 0.03 -0.02 0.10 0.00 0.00 0.00 0.00 23.12 23.23 1zdx s ALA 45 CO 0.21 -0.68 0.20 0.99 0.00 0.00 0.00 175.76 176.48 1zdx s THR 46 N -2.43 -0.27 0.27 0.00 2.01 -1.26 -0.30 115.64 113.66 1zdx s THR 46 Ca 0.10 -0.32 -0.09 0.00 0.31 0.00 0.00 61.69 61.69 1zdx s THR 46 Cb 0.00 -0.79 -0.00 0.00 0.01 0.00 0.00 72.50 71.72 1zdx s THR 46 CO -0.04 -0.37 0.46 0.00 -0.69 0.00 0.00 174.62 173.97 1zdx s ARG 47 N 2.27 1.63 -0.91 4.92 1.70 -0.84 -4.94 118.95 122.77 1zdx s ARG 47 Ca 0.07 -1.41 -0.24 0.00 -0.47 0.00 0.00 55.73 53.68 1zdx s ARG 47 Cb -0.15 0.45 0.05 0.00 -0.57 0.00 0.00 34.95 34.72 1zdx s ARG 47 CO -0.21 -0.67 1.37 -0.51 -1.08 0.00 0.00 175.30 174.20 1zdx s ASP 48 N -3.08 6.38 -0.61 -2.89 1.01 -1.26 -1.39 116.67 114.82 1zdx s ASP 48 Ca 0.26 -1.11 -0.28 0.00 0.71 0.00 0.00 52.55 52.12 1zdx s ASP 48 Cb -0.00 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.40 1zdx s ASP 48 CO 0.12 -1.61 1.24 -0.69 0.21 0.00 0.00 175.17 174.44 1zdx s VAL 49 N 5.15 3.92 -0.48 -1.27 1.01 0.36 -4.70 120.40 124.39 1zdx s VAL 49 Ca 0.41 0.77 -0.28 0.00 0.00 0.00 0.00 61.98 62.89 1zdx s VAL 49 Cb -0.03 -4.74 -0.01 0.00 0.00 0.00 0.00 36.38 31.60 1zdx s VAL 49 CO -0.01 -1.44 1.66 -0.89 0.00 0.00 0.00 175.10 174.42 1zdx s THR 50 N 5.25 3.59 0.91 3.92 2.01 -1.26 -2.13 115.64 127.93 1zdx s THR 50 Ca 0.42 0.52 -0.14 0.00 0.31 0.00 0.00 61.69 62.80 1zdx s THR 50 Cb -0.08 -4.02 0.15 0.00 0.01 0.00 0.00 72.50 68.56 1zdx s THR 50 CO 0.23 -0.81 1.25 0.72 -0.69 0.00 0.00 174.62 175.33 1zdx s PHE 51 N 7.06 2.14 0.45 4.92 -0.71 -1.04 -0.92 117.98 129.89 1zdx s PHE 51 Ca 0.66 0.52 0.03 0.00 -1.04 0.00 0.00 56.93 57.10 1zdx s PHE 51 Cb -0.15 -3.82 -0.03 0.00 -1.21 0.00 0.00 43.02 37.81 1zdx s PHE 51 CO 0.28 -2.34 0.04 -0.80 -1.34 0.00 0.00 175.22 171.06 1zdx s ASN 52 N -4.69 3.61 0.86 1.98 0.02 0.22 -4.41 114.94 112.52 1zdx s ASN 52 Ca 0.69 -1.58 -0.11 0.00 -1.02 0.00 0.00 52.86 50.84 1zdx s ASN 52 Cb -0.07 0.28 0.11 0.00 0.02 0.00 0.00 41.25 41.58 1zdx s ASN 52 CO 0.52 -0.77 1.10 -0.89 0.02 0.00 0.00 177.10 177.08 1zdx s THR 53 N -2.96 2.78 0.00 1.60 2.01 -1.26 -1.52 115.64 116.29 1zdx s THR 53 Ca 0.18 0.25 0.00 0.00 0.31 0.00 0.00 61.69 62.44 1zdx s THR 53 Cb 0.04 -2.58 0.00 0.00 0.01 0.00 0.00 72.50 69.97 1zdx s THR 53 CO 0.10 -0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.31 1zdx n GLY 54 N -0.69 2.13 2.86 4.40 0.00 0.24 -4.35 105.19 109.79 1zdx n GLY 54 Ca 0.09 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 1zdx n GLY 54 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1zdx s ASP 55 N 2.00 0.63 0.00 1.61 2.15 -1.26 -4.49 116.67 117.32 1zdx s ASP 55 Ca 0.00 0.03 0.00 0.00 0.43 0.00 0.00 52.55 53.01 1zdx s ASP 55 Cb 0.00 0.88 0.00 0.00 -0.30 0.00 0.00 42.92 43.50 1zdx s ASP 55 CO 0.00 -0.31 0.00 -1.20 -0.17 0.00 0.00 175.17 173.49 1zdx n SER 56 N 5.35 0.00 -0.21 -0.34 7.64 -1.23 -4.77 113.62 120.06 1zdx n SER 56 Ca -0.04 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.79 1zdx n SER 56 Cb 0.50 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.65 1zdx n SER 56 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1zdx n GLU 57 N 0.00 -0.22 -0.00 1.43 -0.58 -1.26 -1.24 120.64 118.77 1zdx n GLU 57 Ca 0.00 0.78 0.05 0.00 -0.42 0.00 0.00 57.16 57.57 1zdx n GLU 57 Cb 0.00 -1.15 -0.08 0.00 -0.57 0.00 0.00 31.44 29.65 1zdx n GLU 57 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1zdx n GLN 58 N -4.53 0.38 -0.15 3.49 3.00 -1.26 -4.65 117.38 113.66 1zdx n GLN 58 Ca 0.01 -0.09 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1zdx n GLN 58 Cb 0.13 -1.23 0.00 0.00 0.00 0.00 0.00 30.24 29.14 1zdx n GLN 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1zdx n GLY 59 N 1.93 0.91 3.18 1.08 0.00 -1.17 -1.23 105.19 109.89 1zdx n GLY 59 Ca -0.02 -0.13 -0.17 0.00 0.00 0.00 0.00 46.02 45.70 1zdx n GLY 59 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1zdx s ILE 60 N -2.00 1.10 0.02 -0.61 -4.36 -1.26 -0.59 121.20 113.49 1zdx s ILE 60 Ca 0.00 -1.45 0.03 0.00 -0.26 0.00 0.00 60.65 58.97 1zdx s ILE 60 Cb 0.00 -1.20 -0.01 0.00 1.25 0.00 0.00 42.46 42.50 1zdx s ILE 60 CO 0.00 -0.34 -0.08 0.68 0.24 0.00 0.00 174.94 175.44 1zdx s VAL 61 N -1.69 0.62 0.59 8.37 -7.23 -0.57 -4.76 120.40 115.73 1zdx s VAL 61 Ca 0.01 -0.63 -0.19 0.00 -1.81 0.00 0.00 61.98 59.36 1zdx s VAL 61 Cb -0.08 -0.58 -0.03 0.00 0.56 0.00 0.00 36.38 36.25 1zdx s VAL 61 CO 0.02 -0.03 1.24 -2.16 -0.31 0.00 0.00 175.10 173.86 1zdx s PRO 62 N -0.73 2.95 0.37 4.82 0.04 -1.26 -0.61 135.00 140.58 1zdx s PRO 62 Ca -0.01 1.92 -0.26 0.00 0.04 0.00 0.00 61.00 62.68 1zdx s PRO 62 Cb -0.06 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 1zdx s PRO 62 CO 0.00 -1.24 1.15 0.00 0.04 0.00 0.00 177.00 176.95 1zdx s LEU 64 N -2.26 -1.02 0.49 0.00 0.05 -1.26 -4.76 118.68 109.93 1zdx s LEU 64 Ca 0.54 1.45 0.06 0.00 0.05 0.00 0.00 54.13 56.23 1zdx s LEU 64 Cb -0.30 2.23 0.01 0.00 -2.05 0.00 0.00 46.19 46.08 1zdx s LEU 64 CO 0.39 -0.21 0.38 0.42 -0.55 0.00 0.00 176.35 176.77 1zdx s THR 65 N 2.52 2.01 0.42 5.48 -4.23 -1.25 -0.43 115.64 120.16 1zdx s THR 65 Ca -0.07 -1.47 0.11 0.00 -1.18 0.00 0.00 61.69 59.09 1zdx s THR 65 Cb -0.09 -2.48 0.31 0.00 1.34 0.00 0.00 72.50 71.57 1zdx s THR 65 CO -0.19 0.00 1.99 0.03 -0.54 0.00 0.00 174.62 175.91 1zdx h ARG 66 N 0.90 0.47 0.28 3.99 2.47 -1.65 -0.30 114.38 120.54 1zdx h ARG 66 Ca -0.39 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.29 1zdx h ARG 66 Cb 1.29 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1zdx h ARG 66 CO 0.59 0.31 -0.14 0.00 0.56 0.00 0.00 179.97 181.29 1zdx h ALA 67 N 1.70 -0.38 -0.22 0.04 0.00 -1.82 -2.68 119.26 115.91 1zdx h ALA 67 Ca 0.25 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.05 1zdx h ALA 67 Cb 0.37 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1zdx h ALA 67 CO -0.07 -0.42 0.18 1.96 0.00 0.00 0.00 179.25 180.90 1zdx h GLN 68 N -0.97 0.00 0.10 0.00 1.08 -1.69 0.22 115.11 113.85 1zdx h GLN 68 Ca -0.04 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.93 1zdx h GLN 68 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1zdx h GLN 68 CO 0.06 0.00 -1.14 -0.07 -0.95 0.00 0.00 178.83 176.73 1zdx h LEU 69 N 0.00 0.35 -1.25 1.46 3.38 -1.19 -3.16 115.31 114.89 1zdx h LEU 69 Ca 0.10 -0.86 0.00 0.00 0.09 0.00 0.00 57.88 57.21 1zdx h LEU 69 Cb 0.46 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1zdx h LEU 69 CO -0.00 1.50 0.00 0.00 0.09 0.00 0.00 178.44 180.03 1zdx h ALA 70 N -0.04 1.00 0.51 1.53 0.00 -0.96 0.23 119.26 121.52 1zdx h ALA 70 Ca -0.24 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1zdx h ALA 70 Cb 1.64 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.43 1zdx h ALA 70 CO 0.06 0.00 -0.25 0.77 0.00 0.00 0.00 179.25 179.83 1zdx h SER 71 N 0.00 -0.58 0.08 0.00 0.02 -0.60 -2.43 113.55 110.03 1zdx h SER 71 Ca 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1zdx h SER 71 Cb 0.23 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1zdx h SER 71 CO 0.00 -0.25 0.00 1.15 -1.14 0.00 0.00 176.83 176.59 1zdx n MET 72 N -5.30 0.19 -0.57 3.45 0.00 -1.02 -4.86 117.12 109.02 1zdx n MET 72 Ca -0.11 0.11 0.00 0.00 0.00 0.00 0.00 57.70 57.69 1zdx n MET 72 Cb 0.32 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.04 1zdx n MET 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1zdx n GLY 73 N -0.52 0.70 3.71 3.17 0.00 -0.66 -4.46 105.19 107.13 1zdx n GLY 73 Ca 0.05 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1zdx n GLY 73 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1zdx n LEU 74 N 0.00 4.33 -4.32 0.99 -0.00 -0.02 -0.65 117.00 117.33 1zdx n LEU 74 Ca 0.00 1.07 -0.46 0.00 -0.00 0.00 0.00 56.01 56.62 1zdx n LEU 74 Cb 0.00 -1.51 -0.05 0.00 -0.00 0.00 0.00 43.42 41.85 1zdx n LEU 74 CO 0.00 -0.68 0.13 0.21 -0.00 0.00 0.00 177.39 177.06 1zdx s ASN 75 N -0.63 6.18 0.33 1.96 3.84 -0.02 -4.14 114.94 122.46 1zdx s ASN 75 Ca 0.64 -1.73 0.26 0.00 0.21 0.00 0.00 52.86 52.24 1zdx s ASN 75 Cb -0.48 -2.21 1.05 0.00 -0.55 0.00 0.00 41.25 39.06 1zdx s ASN 75 CO 0.56 -0.84 1.78 0.71 -2.79 0.00 0.00 177.10 176.52 1zdx h THR 76 N 5.87 0.00 -0.02 -5.21 1.35 -1.91 -3.06 112.91 109.94 1zdx h THR 76 Ca -0.30 -0.35 -0.21 0.00 -0.55 0.00 0.00 66.41 65.00 1zdx h THR 76 Cb 1.10 1.18 -0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1zdx h THR 76 CO 1.02 0.00 -0.89 0.00 -0.25 0.00 0.00 175.52 175.40 1zdx h ALA 77 N 2.22 0.43 -0.09 6.62 0.00 -1.95 -3.12 119.26 123.36 1zdx h ALA 77 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 54.91 54.25 1zdx h ALA 77 Cb 0.45 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1zdx h ALA 77 CO 0.00 0.82 0.10 0.77 0.00 0.00 0.00 179.25 180.93 1zdx h SER 78 N 0.23 0.00 -3.70 0.00 0.02 -1.91 -3.37 113.55 104.81 1zdx h SER 78 Ca -0.07 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 60.21 1zdx h SER 78 Cb 1.51 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 63.69 1zdx h SER 78 CO 0.15 0.00 -0.70 0.54 -1.14 0.00 0.00 176.83 175.68 1zdx s VAL 79 N -4.71 2.59 0.14 2.27 0.11 -1.22 -5.03 120.40 114.54 1zdx s VAL 79 Ca -0.05 -1.95 -0.35 0.00 -2.93 0.00 0.00 61.98 56.71 1zdx s VAL 79 Cb 0.16 -2.72 -0.15 0.00 -1.53 0.00 0.00 36.38 32.14 1zdx s VAL 79 CO 0.57 -0.40 1.46 0.00 -3.33 0.00 0.00 175.10 173.40 1zdx n ALA 80 N 4.43 0.33 -0.08 1.54 0.00 -1.26 -1.27 120.51 124.19 1zdx n ALA 80 Ca -0.05 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1zdx n ALA 80 Cb 0.42 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1zdx n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zdx n GLY 81 N 2.92 0.64 0.13 0.00 0.00 -1.26 -4.92 105.19 102.70 1zdx n GLY 81 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 1zdx n GLY 81 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1zdx n MET 82 N -2.00 0.68 0.00 1.61 0.00 -0.40 -4.52 117.12 112.49 1zdx n MET 82 Ca 0.00 0.17 0.04 0.00 0.00 0.00 0.00 57.70 57.91 1zdx n MET 82 Cb 0.00 -1.59 0.21 0.00 0.00 0.00 0.00 33.22 31.84 1zdx n MET 82 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 1zdx n ASN 83 N -3.26 0.00 0.00 6.12 0.23 -1.18 -1.85 115.26 115.33 1zdx n ASN 83 Ca -0.39 -0.49 0.00 0.00 -0.53 0.00 0.00 54.58 53.16 1zdx n ASN 83 Cb 1.03 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.73 1zdx n ASN 83 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1zdx n LEU 84 N -0.81 0.67 -4.90 -4.53 -0.00 -1.26 -5.05 117.00 101.12 1zdx n LEU 84 Ca 0.05 -0.80 -0.29 0.00 -0.00 0.00 0.00 56.01 54.97 1zdx n LEU 84 Cb 0.02 0.00 0.09 0.00 -0.00 0.00 0.00 43.42 43.54 1zdx n LEU 84 CO 0.04 0.17 0.79 -0.76 -0.00 0.00 0.00 177.39 177.63 1zdx s LEU 85 N -0.51 2.49 0.31 1.47 1.43 -0.77 -5.09 118.68 118.01 1zdx s LEU 85 Ca 0.00 0.77 0.03 0.00 -1.03 0.00 0.00 54.13 53.90 1zdx s LEU 85 Cb 0.00 -3.24 -0.03 0.00 0.03 0.00 0.00 46.19 42.95 1zdx s LEU 85 CO 0.00 -1.96 0.47 0.00 0.23 0.00 0.00 176.35 175.10 1zdx s ALA 86 N -3.58 3.83 -1.50 4.21 0.00 -1.26 -4.91 121.76 118.55 1zdx s ALA 86 Ca 0.62 -1.08 0.18 0.00 0.00 0.00 0.00 51.96 51.68 1zdx s ALA 86 Cb -0.11 -1.93 0.92 0.00 0.00 0.00 0.00 23.12 22.00 1zdx s ALA 86 CO 0.49 0.07 1.53 -0.40 0.00 0.00 0.00 175.76 177.44 1zdx n ASP 87 N -1.64 0.00 -2.59 0.00 3.85 -1.26 -1.88 116.55 113.03 1zdx n ASP 87 Ca -0.06 -0.04 -0.00 0.00 -0.71 0.00 0.00 54.79 53.98 1zdx n ASP 87 Cb 0.57 -0.25 0.05 0.00 -1.35 0.00 0.00 41.12 40.13 1zdx n ASP 87 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1zdx n ASP 88 N -1.25 1.64 -4.84 -1.12 9.92 -1.26 -3.87 116.55 115.76 1zdx n ASP 88 Ca 0.09 -2.11 -0.37 0.00 -0.53 0.00 0.00 54.79 51.87 1zdx n ASP 88 Cb 0.13 -0.45 -0.06 0.00 -0.64 0.00 0.00 41.12 40.11 1zdx n ASP 88 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1zdx s ALA 89 N -3.23 3.65 -0.87 2.24 0.00 -0.79 -5.02 121.76 117.75 1zdx s ALA 89 Ca 0.29 -0.17 -0.25 0.00 0.00 0.00 0.00 51.96 51.83 1zdx s ALA 89 Cb 0.33 -2.46 -0.10 0.00 0.00 0.00 0.00 23.12 20.90 1zdx s ALA 89 CO -0.06 0.47 2.16 0.00 0.00 0.00 0.00 175.76 178.34 1zdx s VAL 91 N 12.50 2.66 -1.34 0.00 1.01 0.43 -4.85 120.40 130.81 1zdx s VAL 91 Ca 0.81 0.62 -0.09 0.00 0.00 0.00 0.00 61.98 63.32 1zdx s VAL 91 Cb -0.09 -3.39 -0.08 0.00 0.00 0.00 0.00 36.38 32.81 1zdx s VAL 91 CO 0.04 0.13 2.98 -0.81 0.00 0.00 0.00 175.10 177.44 1zdx n PRO 92 N 1.42 3.56 0.01 2.72 -0.04 -1.26 -4.68 135.00 136.72 1zdx n PRO 92 Ca 0.03 -2.20 0.02 0.00 -0.04 0.00 0.00 63.50 61.30 1zdx n PRO 92 Cb 0.41 -2.65 0.07 0.00 -0.04 0.00 0.00 33.50 31.29 1zdx n PRO 92 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1zdx n LEU 93 N 3.12 0.03 0.00 1.53 -0.00 -1.26 -0.92 117.00 119.50 1zdx n LEU 93 Ca 0.71 0.51 0.00 0.00 -0.00 0.00 0.00 56.01 57.23 1zdx n LEU 93 Cb 0.33 -0.51 0.00 0.00 -0.00 0.00 0.00 43.42 43.24 1zdx n LEU 93 CO 0.72 -0.49 0.37 0.35 -0.00 0.00 0.00 177.39 178.34 1zdx n THR 94 N -1.54 0.50 -0.07 1.96 -2.24 -1.26 -4.15 114.28 107.48 1zdx n THR 94 Ca 0.00 -0.53 -0.06 0.00 -2.27 0.00 0.00 64.05 61.19 1zdx n THR 94 Cb 0.03 0.79 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 1zdx n THR 94 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1zdx n THR 95 N -0.25 1.20 0.53 4.28 -1.04 -0.36 -4.67 114.28 113.97 1zdx n THR 95 Ca 0.00 0.22 0.07 0.00 -2.04 0.00 0.00 64.05 62.31 1zdx n THR 95 Cb 0.34 -2.20 0.32 0.00 -1.82 0.00 0.00 70.33 66.98 1zdx n THR 95 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1zdx n MET 96 N -4.11 0.02 -4.12 -2.82 2.81 -0.10 -4.31 117.12 104.49 1zdx n MET 96 Ca -0.10 0.24 -0.32 0.00 -1.81 0.00 0.00 57.70 55.71 1zdx n MET 96 Cb 0.37 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.22 1zdx n MET 96 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1zdx s VAL 97 N -2.97 1.85 0.87 2.03 -7.23 -1.26 -4.98 120.40 108.71 1zdx s VAL 97 Ca 0.08 -0.81 -0.13 0.00 -1.81 0.00 0.00 61.98 59.31 1zdx s VAL 97 Cb 0.10 -1.69 0.11 0.00 0.56 0.00 0.00 36.38 35.46 1zdx s VAL 97 CO 0.27 0.51 1.18 -1.58 -0.31 0.00 0.00 175.10 175.16 1zdx s GLN 98 N 1.34 1.50 0.00 4.82 0.74 -1.26 -4.40 119.66 122.40 1zdx s GLN 98 Ca 0.04 0.11 0.00 0.00 0.05 0.00 0.00 55.36 55.56 1zdx s GLN 98 Cb -0.13 -1.90 0.00 0.00 1.10 0.00 0.00 33.01 32.08 1zdx s GLN 98 CO -0.11 -1.91 0.00 -3.47 -0.55 0.00 0.00 175.29 169.24 1zdx n ASP 99 N -3.54 0.00 -3.53 6.67 4.64 -1.26 -4.65 116.55 114.89 1zdx n ASP 99 Ca 0.08 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 53.19 1zdx n ASP 99 Cb 0.60 -0.07 0.27 0.00 -1.04 0.00 0.00 41.12 40.88 1zdx n ASP 99 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1zdx s ALA 100 N -0.08 0.05 -0.21 -1.67 0.00 -1.26 -4.72 121.76 113.86 1zdx s ALA 100 Ca 0.00 -0.99 -0.33 0.00 0.00 0.00 0.00 51.96 50.64 1zdx s ALA 100 Cb 0.00 -2.87 0.15 0.00 0.00 0.00 0.00 23.12 20.40 1zdx s ALA 100 CO 0.00 -4.09 1.23 0.95 0.00 0.00 0.00 175.76 173.85 1zdx s THR 101 N -2.72 0.00 -0.38 0.00 -4.23 -1.08 -4.95 115.64 102.28 1zdx s THR 101 Ca 0.71 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.22 1zdx s THR 101 Cb -0.09 -1.00 0.14 0.00 1.34 0.00 0.00 72.50 72.88 1zdx s THR 101 CO 0.56 0.00 0.22 0.00 -0.54 0.00 0.00 174.62 174.86 1zdx s ALA 102 N -1.87 1.30 -0.16 3.99 0.00 -1.26 -2.37 121.76 121.40 1zdx s ALA 102 Ca 0.08 -2.07 -0.06 0.00 0.00 0.00 0.00 51.96 49.90 1zdx s ALA 102 Cb -0.01 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1zdx s ALA 102 CO -0.05 -2.09 0.06 -3.38 0.00 0.00 0.00 175.76 170.31 1zdx s HIS 103 N 0.87 3.28 -0.22 0.00 -3.43 -0.58 -4.65 115.29 110.55 1zdx s HIS 103 Ca 0.18 0.14 -0.22 0.00 -0.80 0.00 0.00 55.06 54.36 1zdx s HIS 103 Cb -0.23 -2.00 -0.02 0.00 -1.43 0.00 0.00 32.58 28.90 1zdx s HIS 103 CO 0.00 0.28 0.71 -1.17 -2.00 0.00 0.00 174.74 172.56 1zdx s LEU 104 N -0.05 4.10 -0.71 5.38 2.96 -1.26 -0.77 118.68 128.35 1zdx s LEU 104 Ca 0.06 0.89 -0.19 0.00 -0.22 0.00 0.00 54.13 54.67 1zdx s LEU 104 Cb -0.12 -3.00 0.12 0.00 0.50 0.00 0.00 46.19 43.69 1zdx s LEU 104 CO 0.01 -0.38 0.85 -0.62 -1.32 0.00 0.00 176.35 174.89 1zdx s ASP 105 N 1.32 6.35 0.46 3.68 -1.08 0.27 -4.93 116.67 122.73 1zdx s ASP 105 Ca 0.31 -1.64 0.21 0.00 -0.52 0.00 0.00 52.55 50.90 1zdx s ASP 105 Cb -0.16 -2.33 1.12 0.00 -1.46 0.00 0.00 42.92 40.09 1zdx s ASP 105 CO 0.09 -1.10 1.97 0.58 0.52 0.00 0.00 175.17 177.23 1zdx h VAL 106 N 5.78 0.86 0.00 1.11 2.07 -1.95 0.11 116.25 124.24 1zdx h VAL 106 Ca -0.15 -0.81 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 1zdx h VAL 106 Cb 1.06 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.30 1zdx h VAL 106 CO 1.08 0.21 -0.40 1.23 0.02 0.00 0.00 177.57 179.70 1zdx h GLY 107 N 0.97 0.00 -0.65 2.17 0.00 -1.95 -2.77 103.07 100.84 1zdx h GLY 107 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1zdx h GLY 107 CO 0.03 0.00 -0.01 -0.18 0.00 0.00 0.00 176.54 176.38 1zdx n GLN 108 N -3.99 0.25 -3.61 4.80 -0.06 -1.23 -5.01 117.38 108.53 1zdx n GLN 108 Ca -0.02 -0.97 -0.24 0.00 -2.00 0.00 0.00 57.00 53.77 1zdx n GLN 108 Cb 0.44 -1.15 0.04 0.00 -4.06 0.00 0.00 30.24 25.51 1zdx n GLN 108 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 1zdx n GLN 109 N 0.43 -2.92 -3.89 3.69 6.02 -0.12 -4.91 117.38 115.69 1zdx n GLN 109 Ca 0.05 0.60 -0.29 0.00 -0.01 0.00 0.00 57.00 57.35 1zdx n GLN 109 Cb 0.20 -4.89 -0.16 0.00 1.02 0.00 0.00 30.24 26.41 1zdx n GLN 109 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1zdx s ARG 110 N -5.67 1.40 -0.87 -1.09 3.52 0.21 -0.99 118.95 115.47 1zdx s ARG 110 Ca 0.27 -0.64 -0.24 0.00 -0.13 0.00 0.00 55.73 55.00 1zdx s ARG 110 Cb -0.08 -2.19 0.06 0.00 -1.56 0.00 0.00 34.95 31.18 1zdx s ARG 110 CO 0.82 -0.50 1.28 -1.17 -0.81 0.00 0.00 175.30 174.92 1zdx s LEU 111 N 1.59 3.71 -0.35 -0.88 2.96 0.53 -0.57 118.68 125.67 1zdx s LEU 111 Ca -0.01 -1.13 -0.28 0.00 -0.22 0.00 0.00 54.13 52.49 1zdx s LEU 111 Cb -0.16 -2.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 1zdx s LEU 111 CO -0.07 -1.55 1.94 0.20 -1.32 0.00 0.00 176.35 175.55 1zdx s ASN 112 N 4.21 5.60 -0.13 3.68 0.01 0.05 -1.38 114.94 126.99 1zdx s ASN 112 Ca 0.37 1.29 0.03 0.00 -0.71 0.00 0.00 52.86 53.84 1zdx s ASN 112 Cb -0.06 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 39.09 1zdx s ASN 112 CO 0.01 -1.94 -0.22 -0.76 -1.51 0.00 0.00 177.10 172.68 1zdx s LEU 113 N 7.89 2.09 0.06 0.60 2.01 -0.72 -1.53 118.68 129.09 1zdx s LEU 113 Ca 0.84 -0.59 0.06 0.00 0.01 0.00 0.00 54.13 54.45 1zdx s LEU 113 Cb -0.23 -1.43 -0.03 0.00 0.01 0.00 0.00 46.19 44.52 1zdx s LEU 113 CO 0.32 0.10 -0.16 -0.89 1.01 0.00 0.00 176.35 176.72 1zdx s THR 114 N 0.71 1.30 -0.01 5.49 2.01 -1.00 -0.94 115.64 123.20 1zdx s THR 114 Ca -0.10 -1.24 -0.01 0.00 0.31 0.00 0.00 61.69 60.65 1zdx s THR 114 Cb -0.16 -1.20 0.00 0.00 0.01 0.00 0.00 72.50 71.16 1zdx s THR 114 CO 0.01 -0.06 0.03 -0.63 -0.69 0.00 0.00 174.62 173.28 1zdx s ILE 115 N -1.05 -0.00 -1.55 1.82 1.01 -1.26 -2.63 121.20 117.55 1zdx s ILE 115 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.67 1zdx s ILE 115 Cb -0.09 -0.06 0.00 0.00 0.01 0.00 0.00 42.46 42.32 1zdx s ILE 115 CO 0.02 0.00 0.00 -0.81 0.00 0.00 0.00 174.94 174.15 1zdx n PRO 116 N 3.07 0.00 0.00 2.79 -0.04 -1.26 -4.77 135.00 134.78 1zdx n PRO 116 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1zdx n PRO 116 Cb 0.60 -0.99 0.00 0.00 -0.04 0.00 0.00 33.50 33.07 1zdx n PRO 116 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1zdx n GLN 117 N -0.29 0.00 -0.09 0.54 1.13 -1.26 -4.66 117.38 112.75 1zdx n GLN 117 Ca 0.00 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.97 1zdx n GLN 117 Cb 0.00 -1.55 -0.02 0.00 0.11 0.00 0.00 30.24 28.78 1zdx n GLN 117 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1zdx h ALA 118 N 0.00 0.38 0.00 -1.58 0.00 -2.02 -2.48 119.26 113.56 1zdx h ALA 118 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1zdx h ALA 118 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1zdx h ALA 118 CO 0.00 -0.12 0.00 1.19 0.00 0.00 0.00 179.25 180.32 1zdx n PHE 119 N -4.85 0.00 -3.95 0.00 3.01 -1.26 -4.71 117.46 105.70 1zdx n PHE 119 Ca -0.01 -0.88 -0.29 0.00 1.01 0.00 0.00 57.45 57.28 1zdx n PHE 119 Cb 0.05 -0.44 -0.16 0.00 -0.01 0.00 0.00 39.48 38.91 1zdx n PHE 119 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1zdx s MET 120 N 0.03 1.78 -0.55 -1.08 -1.94 -0.94 -0.84 119.30 115.77 1zdx s MET 120 Ca 0.00 -0.63 -0.27 0.00 -1.71 0.00 0.00 55.69 53.07 1zdx s MET 120 Cb 0.00 -2.15 -0.01 0.00 2.01 0.00 0.00 34.83 34.68 1zdx s MET 120 CO 0.00 -0.39 1.73 0.45 -0.01 0.00 0.00 175.02 176.79 1zdx s SER 121 N 1.53 5.62 0.00 3.03 0.15 0.18 -4.58 113.70 119.62 1zdx s SER 121 Ca 0.01 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.14 1zdx s SER 121 Cb -0.15 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1zdx s SER 121 CO -0.08 -2.08 0.00 -3.20 1.20 0.00 0.00 173.24 169.08 1zdx n ASN 122 N 11.43 0.00 0.00 5.45 2.85 -1.26 -3.92 115.26 129.81 1zdx n ASN 122 Ca 0.18 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.65 1zdx n ASN 122 Cb 0.50 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.52 1zdx n ASN 122 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1zdx n ARG 123 N 0.00 0.00 -3.76 1.20 1.74 -1.26 -4.99 116.66 109.59 1zdx n ARG 123 Ca 0.00 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.82 1zdx n ARG 123 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 1zdx n ARG 123 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1zdx n ALA 124 N 0.00 -1.34 0.17 7.54 0.00 -1.25 -5.11 120.51 120.52 1zdx n ALA 124 Ca 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 53.44 53.22 1zdx n ALA 124 Cb 0.00 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.39 1zdx n ALA 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04